Johannes P. Dürholt

Problem with Polytope Sampler

3

Hi, I encountered a problem with the `get_polytope_samples` when the individual variables live in different dimensions. Here is a small didactic example: ``` from torch import tensor from botorch.utils.sampling import...

add mixed optimization for list optimization

1

## Motivation As outlined in issue https://github.com/pytorch/botorch/issues/1272, `optimize_acqf_list` cannot be used to optimize over mixed domains. For this reason, this PR introduces the argument `fixed_features_list` for `òptimize_acqf_list`. Calling `optimize_acqf_list` with...

[Feature Request] optimize_acqf_list_mixed

1

# 🚀 Feature Request So far `botorch` offers helper functions to optimize a list of acquisition functions and to optimize over a mixed domain. A combination is not yet straight-forward...

Non GP model types in Botorch

12

Hi, I was thinking about the possibility to use non GP models within botorch. For example to use a GP for one objective and a neural network (ensemble) for another...

Classification Model as Output Constraint

28

Dear botorch developers, I have a question regarding output constraints. So far they are used and implemented in the following way: - There is a property which should be larger...

Model specific Arguments in batch_cross_validation

9

Hi Botorch developers, I came across the functionality of performing LOOCV directly within botorch and I like it. Only one thing is missing for me: One cannot pass modelspecific arguments...

Feature Request: Periodic boundary conditions included in atomic environment display

4

Hi, I was wondering how complex it would be to include PBCs in the calculation and display of atoms within the cutoff radius for an atom. At least from my...

[Feature Request] Non-default categorical kernel in mixedGP

6

# 🚀 Feature Request I looked into the definition of `MixedSingleTaskGP`, so far one is only able to specify a `cont_kernel_factory` to use a non-default kernel for the continuous domains....

Include BoFire into awesome-pydantic

Feature Scaling in DoE

7

Hi @Osburg, this is my interpretation of the scaling as discussed in https://github.com/experimental-design/bofire/pull/354 and https://github.com/experimental-design/bofire/issues/343. What do you think? No testing etc. yet. Feel also free, to proceed just from...